Amber Molecular Dynamics
Methods IPC, Koslowski
| Amber | Model: | Version 10 |
| Unit and Room: | Physical Chemistry, various |
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| Responsible: | Prof. Thorsten Koslowski |
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| Molecular Dynamics | Further information: | www.theochem.uni-freiburg.de |
| Short Description: Amber 10 molecular dynamics package with various extensions |
Picture of the Equipment
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| Available Experiments/Techniques: Molecular dynamics in a variety of ensembles, thermodyanmic integration methods. |
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| Special Equipment: Extension to combined quantum mechanics - classical mechanics simulations |
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| Measurements on the equipment are currently done by: | Students after extensive training Trained scientific service personal |
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| Recent Publications, where this instrument was important (citation): |
J. Phys. Chem. B 112, 16935 (2008), PCCP 7, 4039 (2005) (invited article) |
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| Typical problems that may be solved with this instrument: | Direct simulation ot electron transfer, free energy surfaces for reactions |
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Amber Molecular Dynamics (this page as a pdf file)